#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n0f s LEU 27 N 0.00 4.68 0.20 3.17 1.43 -1.02 -4.94 118.68 122.20 1n0f s LEU 27 Ca 0.00 -0.49 0.08 0.00 -1.03 0.00 0.00 54.13 52.68 1n0f s LEU 27 Cb 0.00 -2.55 -0.05 0.00 0.03 0.00 0.00 46.19 43.63 1n0f s LEU 27 CO 0.00 -0.66 -0.14 -0.76 0.23 0.00 0.00 176.35 175.01 1n0f s LEU 28 N 2.45 2.56 0.00 1.79 1.43 -1.26 -0.12 118.68 125.53 1n0f s LEU 28 Ca 0.17 -1.02 0.00 0.00 -1.03 0.00 0.00 54.13 52.25 1n0f s LEU 28 Cb -0.16 -0.66 0.00 0.00 0.03 0.00 0.00 46.19 45.40 1n0f s LEU 28 CO 0.16 -0.17 0.00 0.61 0.23 0.00 0.00 176.35 177.18 1n0f n GLY 29 N -0.38 1.09 3.37 -3.19 0.00 -1.26 -4.41 105.19 100.42 1n0f n GLY 29 Ca -0.08 -2.02 -0.31 0.00 0.00 0.00 0.00 46.02 43.61 1n0f n GLY 29 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1n0f s THR 30 N -1.79 2.41 -0.01 2.61 2.01 -1.26 0.70 115.64 120.31 1n0f s THR 30 Ca 0.00 -1.04 0.00 0.00 0.31 0.00 0.00 61.69 60.96 1n0f s THR 30 Cb 0.00 -1.90 0.02 0.00 0.01 0.00 0.00 72.50 70.63 1n0f s THR 30 CO 0.00 0.54 0.02 -0.36 -0.69 0.00 0.00 174.62 174.12 1n0f s PHE 31 N -0.70 0.02 -0.23 4.92 0.08 0.14 -4.96 117.98 117.25 1n0f s PHE 31 Ca 0.11 0.07 -0.09 0.00 0.12 0.00 0.00 56.93 57.14 1n0f s PHE 31 Cb -0.10 -0.14 -0.04 0.00 -0.57 0.00 0.00 43.02 42.16 1n0f s PHE 31 CO 0.00 -0.05 0.13 -0.80 -0.10 0.00 0.00 175.22 174.40 1n0f s ASN 32 N 0.61 5.84 0.27 1.36 0.01 -1.26 0.00 114.94 121.77 1n0f s ASN 32 Ca -0.05 0.04 0.06 0.00 -0.71 0.00 0.00 52.86 52.19 1n0f s ASN 32 Cb -0.07 -2.05 -0.02 0.00 0.41 0.00 0.00 41.25 39.52 1n0f s ASN 32 CO -0.02 0.06 0.24 2.30 -1.51 0.00 0.00 177.10 178.17 1n0f n ILE 33 N 4.31 0.00 -4.59 0.60 -5.35 -0.40 -5.00 119.36 108.94 1n0f n ILE 33 Ca -0.15 -1.90 -0.23 0.00 -0.27 0.00 0.00 62.75 60.20 1n0f n ILE 33 Cb 0.52 0.96 -0.14 0.00 -1.74 0.00 0.00 39.64 39.24 1n0f n ILE 33 CO 0.00 0.00 0.00 -0.89 -1.76 0.00 0.00 176.55 173.90 1n0f s THR 34 N -3.05 1.26 -0.34 7.28 2.01 -1.26 0.55 115.64 122.09 1n0f s THR 34 Ca 0.31 -0.87 -0.25 0.00 0.31 0.00 0.00 61.69 61.19 1n0f s THR 34 Cb 0.01 -1.09 0.01 0.00 0.01 0.00 0.00 72.50 71.44 1n0f s THR 34 CO 0.22 0.21 0.90 -0.22 -0.69 0.00 0.00 174.62 175.03 1n0f s LEU 35 N -0.76 4.03 0.00 4.42 0.20 -1.26 -4.64 118.68 120.67 1n0f s LEU 35 Ca 0.05 0.67 -0.16 0.00 0.69 0.00 0.00 54.13 55.38 1n0f s LEU 35 Cb -0.07 -3.23 0.23 0.00 -0.43 0.00 0.00 46.19 42.69 1n0f s LEU 35 CO 0.00 -0.77 0.89 -0.90 -0.29 0.00 0.00 176.35 175.28 1n0f n ASP 36 N 6.57 -1.62 0.13 3.68 3.85 -0.56 -4.74 116.55 123.86 1n0f n ASP 36 Ca 0.07 -1.07 0.04 0.00 -0.71 0.00 0.00 54.79 53.11 1n0f n ASP 36 Cb 0.48 -0.79 0.46 0.00 -1.35 0.00 0.00 41.12 39.91 1n0f n ASP 36 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1n0f h ALA 37 N -2.49 1.67 -0.47 2.12 0.00 -1.96 -2.50 119.26 115.63 1n0f h ALA 37 Ca -0.33 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.38 1n0f h ALA 37 Cb 0.98 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.65 1n0f h ALA 37 CO 0.22 0.25 0.11 1.63 0.00 0.00 0.00 179.25 181.45 1n0f n LYS 38 N -4.38 3.32 -3.00 0.00 5.02 -1.26 -4.90 118.16 112.95 1n0f n LYS 38 Ca -0.01 -2.18 -0.22 0.00 -2.02 0.00 0.00 58.31 53.88 1n0f n LYS 38 Cb 0.18 -1.99 0.03 0.00 -0.02 0.00 0.00 35.03 33.23 1n0f n LYS 38 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1n0f n ASN 39 N 0.19 -6.02 -4.75 4.39 5.03 -0.94 -4.83 115.26 108.32 1n0f n ASN 39 Ca 0.25 -0.27 -0.23 0.00 0.87 0.00 0.00 54.58 55.19 1n0f n ASN 39 Cb 1.01 -4.88 -0.06 0.00 -1.02 0.00 0.00 39.78 34.83 1n0f n ASN 39 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 1n0f s ARG 40 N -5.68 2.67 -0.02 3.52 0.52 -1.26 -1.40 118.95 117.30 1n0f s ARG 40 Ca 0.29 -1.16 0.04 0.00 -0.52 0.00 0.00 55.73 54.38 1n0f s ARG 40 Cb -0.13 -2.42 -0.01 0.00 0.52 0.00 0.00 34.95 32.91 1n0f s ARG 40 CO 0.36 0.40 -0.13 0.42 0.02 0.00 0.00 175.30 176.37 1n0f s ILE 41 N -2.12 1.04 -0.25 1.52 1.01 -0.54 -1.50 121.20 120.35 1n0f s ILE 41 Ca 0.32 -0.54 -0.11 0.00 0.00 0.00 0.00 60.65 60.31 1n0f s ILE 41 Cb -0.08 -0.88 -0.05 0.00 0.01 0.00 0.00 42.46 41.47 1n0f s ILE 41 CO 0.23 0.30 0.21 -0.44 0.00 0.00 0.00 174.94 175.23 1n0f s SER 42 N -0.16 6.12 -0.03 3.58 0.01 -1.26 -0.31 113.70 121.65 1n0f s SER 42 Ca 0.02 0.11 -0.30 0.00 1.31 0.00 0.00 55.95 57.09 1n0f s SER 42 Cb -0.07 -2.13 -0.05 0.00 0.21 0.00 0.00 66.02 63.98 1n0f s SER 42 CO 0.00 -0.01 1.43 -0.76 0.41 0.00 0.00 173.24 174.31 1n0f s LEU 43 N 1.43 4.30 0.00 2.44 1.43 0.19 -4.83 118.68 123.65 1n0f s LEU 43 Ca 0.09 2.09 0.00 0.00 -1.03 0.00 0.00 54.13 55.28 1n0f s LEU 43 Cb -0.15 -3.55 0.00 0.00 0.03 0.00 0.00 46.19 42.52 1n0f s LEU 43 CO 0.08 -0.76 0.00 -2.65 0.23 0.00 0.00 176.35 173.25 1n0f n PRO 44 N 5.79 0.00 0.00 1.29 -0.02 -1.26 -4.45 135.00 136.35 1n0f n PRO 44 Ca 0.14 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 1n0f n PRO 44 Cb 0.44 -0.86 0.00 0.00 -0.02 0.00 0.00 33.50 33.05 1n0f n PRO 44 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1n0f n ALA 45 N -0.01 0.00 0.02 3.55 0.00 -1.26 -4.07 120.51 118.75 1n0f n ALA 45 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.34 1n0f n ALA 45 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 1n0f n ALA 45 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1n0f h LYS 46 N 0.00 -0.31 -0.52 0.00 1.57 -2.02 -2.37 116.57 112.92 1n0f h LYS 46 Ca 0.00 0.02 -0.07 0.00 -1.87 0.00 0.00 60.65 58.73 1n0f h LYS 46 Cb 0.00 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.36 1n0f h LYS 46 CO 0.00 -0.21 0.07 -0.07 -0.57 0.00 0.00 179.45 178.67 1n0f h LEU 47 N -0.33 0.84 -1.98 2.94 4.07 -1.89 -3.12 115.31 115.85 1n0f h LEU 47 Ca 0.09 -0.27 0.24 0.00 0.08 0.00 0.00 57.88 58.02 1n0f h LEU 47 Cb 0.45 -0.22 -0.03 0.00 1.08 0.00 0.00 40.66 41.93 1n0f h LEU 47 CO -0.27 0.90 0.63 -0.09 -1.08 0.00 0.00 178.44 178.54 1n0f h ARG 48 N 0.75 0.00 0.38 1.13 2.43 -1.65 -1.57 114.38 115.85 1n0f h ARG 48 Ca 0.16 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.31 1n0f h ARG 48 Cb 0.43 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.97 1n0f h ARG 48 CO 0.01 0.00 -0.37 0.00 -1.51 0.00 0.00 179.97 178.10 1n0f h ALA 49 N 1.53 -1.05 -1.00 2.80 0.00 -1.42 -3.00 119.26 117.11 1n0f h ALA 49 Ca 0.40 -0.14 0.32 0.00 0.00 0.00 0.00 54.91 55.49 1n0f h ALA 49 Cb 1.66 0.60 -0.18 0.00 0.00 0.00 0.00 17.79 19.87 1n0f h ALA 49 CO -0.00 -1.07 0.19 0.35 0.00 0.00 0.00 179.25 178.72 1n0f h PHE 50 N -0.74 0.23 -3.38 0.00 3.57 -1.47 -3.38 116.94 111.77 1n0f h PHE 50 Ca -0.05 0.06 -0.58 0.00 3.53 0.00 0.00 57.97 60.93 1n0f h PHE 50 Cb 0.64 0.06 -0.09 0.00 2.79 0.00 0.00 35.95 39.36 1n0f h PHE 50 CO -0.20 -0.46 -0.05 -0.06 -2.23 0.00 0.00 178.31 175.31 1n0f s PHE 51 N -5.85 3.46 0.00 0.41 0.08 -1.14 -4.99 117.98 109.96 1n0f s PHE 51 Ca -0.12 0.90 0.00 0.00 0.12 0.00 0.00 56.93 57.83 1n0f s PHE 51 Cb 0.31 -2.64 0.00 0.00 -0.57 0.00 0.00 43.02 40.11 1n0f s PHE 51 CO 0.78 0.04 0.00 0.39 -0.10 0.00 0.00 175.22 176.33 1n0f n GLU 52 N 4.19 0.00 0.07 0.44 1.02 -1.26 -4.90 120.64 120.19 1n0f n GLU 52 Ca -0.05 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 56.97 1n0f n GLU 52 Cb 0.51 0.00 -0.02 0.00 -0.02 0.00 0.00 31.44 31.91 1n0f n GLU 52 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1n0f h GLY 53 N 0.00 0.40 -2.79 0.62 0.00 -1.97 -3.45 103.07 95.89 1n0f h GLY 53 Ca 0.00 -0.67 -0.16 0.00 0.00 0.00 0.00 47.33 46.50 1n0f h GLY 53 CO 0.00 0.60 -0.52 -1.35 0.00 0.00 0.00 176.54 175.27 1n0f s SER 54 N -7.02 0.19 0.24 0.19 1.04 -1.26 -0.04 113.70 107.04 1n0f s SER 54 Ca -0.05 -1.11 0.01 0.00 0.48 0.00 0.00 55.95 55.28 1n0f s SER 54 Cb 0.09 0.36 -0.05 0.00 0.10 0.00 0.00 66.02 66.53 1n0f s SER 54 CO 0.85 -0.81 0.11 0.27 0.98 0.00 0.00 173.24 174.64 1n0f s ILE 55 N -4.03 0.38 -0.07 -1.02 -5.25 -0.19 -4.39 121.20 106.64 1n0f s ILE 55 Ca 0.23 -2.00 0.01 0.00 -0.99 0.00 0.00 60.65 57.91 1n0f s ILE 55 Cb 0.06 -2.59 -0.03 0.00 2.95 0.00 0.00 42.46 42.85 1n0f s ILE 55 CO 0.02 -0.00 -0.08 -0.69 -1.79 0.00 0.00 174.94 172.40 1n0f s VAL 56 N -3.88 3.60 -0.11 8.37 1.01 -0.46 -0.39 120.40 128.54 1n0f s VAL 56 Ca 0.38 -0.52 -0.04 0.00 0.00 0.00 0.00 61.98 61.80 1n0f s VAL 56 Cb 0.08 -2.46 -0.05 0.00 0.00 0.00 0.00 36.38 33.94 1n0f s VAL 56 CO 0.13 0.60 -0.13 0.00 0.00 0.00 0.00 175.10 175.70 1n0f n ILE 57 N 2.24 0.59 -0.50 2.22 3.06 -1.26 -2.08 119.36 123.63 1n0f n ILE 57 Ca -0.18 -0.16 0.00 0.00 -2.50 0.00 0.00 62.75 59.91 1n0f n ILE 57 Cb 0.53 -1.52 -0.00 0.00 0.54 0.00 0.00 39.64 39.19 1n0f n ILE 57 CO 0.00 0.00 0.00 -0.46 -2.50 0.00 0.00 176.55 173.59 1n0f n ASN 58 N -3.37 -0.00 -4.84 9.51 0.23 -1.23 -3.04 115.26 112.52 1n0f n ASN 58 Ca -0.21 0.00 -0.36 0.00 -0.53 0.00 0.00 54.58 53.49 1n0f n ASN 58 Cb 0.66 -1.50 -0.06 0.00 -2.08 0.00 0.00 39.78 36.80 1n0f n ASN 58 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1n0f s ARG 59 N -4.73 3.96 0.00 -3.83 1.70 -1.26 -2.06 118.95 112.74 1n0f s ARG 59 Ca 0.00 0.46 0.00 0.00 -0.47 0.00 0.00 55.73 55.72 1n0f s ARG 59 Cb 0.00 -2.99 0.00 0.00 -0.57 0.00 0.00 34.95 31.39 1n0f s ARG 59 CO 0.00 0.52 0.00 0.41 -1.08 0.00 0.00 175.30 175.15 1n0f n GLY 60 N 0.97 2.35 3.92 3.88 0.00 -1.26 -4.67 105.19 110.38 1n0f n GLY 60 Ca -0.07 -2.09 -0.27 0.00 0.00 0.00 0.00 46.02 43.60 1n0f n GLY 60 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1n0f s PHE 61 N 1.36 3.49 -1.63 1.61 0.08 -1.26 -4.22 117.98 117.42 1n0f s PHE 61 Ca 0.00 0.55 -0.02 0.00 0.12 0.00 0.00 56.93 57.59 1n0f s PHE 61 Cb 0.00 -2.05 0.00 0.00 -0.57 0.00 0.00 43.02 40.41 1n0f s PHE 61 CO 0.00 0.11 0.19 0.39 -0.10 0.00 0.00 175.22 175.81 1n0f n GLU 62 N -1.35 -2.69 -3.03 0.44 4.71 -1.26 -3.30 120.64 114.15 1n0f n GLU 62 Ca -0.03 0.92 -0.13 0.00 -0.01 0.00 0.00 57.16 57.92 1n0f n GLU 62 Cb 0.55 -5.64 0.06 0.00 -1.01 0.00 0.00 31.44 25.40 1n0f n GLU 62 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 1n0f n ASN 63 N -2.14 -3.46 0.00 1.62 3.02 -1.26 -5.01 115.26 108.02 1n0f n ASN 63 Ca -0.19 -0.52 0.00 0.00 -0.03 0.00 0.00 54.58 53.84 1n0f n ASN 63 Cb 0.66 -4.18 0.00 0.00 -0.61 0.00 0.00 39.78 35.65 1n0f n ASN 63 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1n0f n LEU 65 N -1.13 -3.91 -4.62 0.00 4.32 -1.26 -2.71 117.00 107.70 1n0f n LEU 65 Ca 0.00 1.48 -0.31 0.00 -0.02 0.00 0.00 56.01 57.16 1n0f n LEU 65 Cb 0.03 -1.99 -0.10 0.00 -1.62 0.00 0.00 43.42 39.74 1n0f n LEU 65 CO 0.00 -0.87 -0.37 -1.61 -1.22 0.00 0.00 177.39 173.32 1n0f s GLU 66 N -1.85 2.50 -0.06 3.23 2.02 -0.87 -1.13 118.70 122.53 1n0f s GLU 66 Ca 0.00 -0.79 0.05 0.00 0.02 0.00 0.00 54.97 54.24 1n0f s GLU 66 Cb 0.00 -2.49 -0.00 0.00 0.10 0.00 0.00 34.13 31.73 1n0f s GLU 66 CO 0.00 0.57 -0.20 0.08 0.02 0.00 0.00 175.26 175.73 1n0f s VAL 67 N -1.12 1.71 0.04 2.63 1.01 0.12 -4.28 120.40 120.52 1n0f s VAL 67 Ca 0.20 -0.86 -0.04 0.00 0.00 0.00 0.00 61.98 61.29 1n0f s VAL 67 Cb -0.11 -1.47 -0.02 0.00 0.00 0.00 0.00 36.38 34.77 1n0f s VAL 67 CO 0.12 0.48 0.04 -0.13 0.00 0.00 0.00 175.10 175.61 1n0f s ARG 68 N 0.11 0.58 0.33 2.72 0.52 -0.88 -0.81 118.95 121.52 1n0f s ARG 68 Ca -0.08 -0.91 -0.28 0.00 -0.52 0.00 0.00 55.73 53.94 1n0f s ARG 68 Cb -0.14 0.22 -0.09 0.00 0.52 0.00 0.00 34.95 35.45 1n0f s ARG 68 CO 0.04 -0.13 1.15 0.15 0.02 0.00 0.00 175.30 176.53 1n0f s LYS 69 N -3.00 4.38 0.25 3.54 1.02 -1.26 -1.35 119.74 123.32 1n0f s LYS 69 Ca -0.02 1.87 -0.04 0.00 0.02 0.00 0.00 55.97 57.80 1n0f s LYS 69 Cb 0.01 -2.97 0.50 0.00 -0.52 0.00 0.00 37.83 34.86 1n0f s LYS 69 CO -0.06 -0.04 1.66 -1.35 -0.92 0.00 0.00 175.35 174.63 1n0f h PRO 70 N 3.29 0.19 -0.70 -1.68 0.11 -1.90 0.30 132.00 131.60 1n0f h PRO 70 Ca -0.48 -0.01 0.11 0.00 0.11 0.00 0.00 66.00 65.74 1n0f h PRO 70 Cb 1.22 -0.04 -0.08 0.00 0.11 0.00 0.00 31.00 32.21 1n0f h PRO 70 CO 0.65 0.12 0.29 1.96 -0.21 0.00 0.00 178.00 180.82 1n0f h GLN 71 N 0.19 0.46 -0.38 1.05 7.50 -1.96 0.26 115.11 122.23 1n0f h GLN 71 Ca 0.44 -0.03 -0.12 0.00 0.50 0.00 0.00 58.65 59.45 1n0f h GLN 71 Cb 0.80 -0.10 -0.01 0.00 0.05 0.00 0.00 27.48 28.22 1n0f h GLN 71 CO -0.60 0.31 -0.22 -0.44 -1.50 0.00 0.00 178.83 176.38 1n0f h ASP 72 N 0.48 0.85 -0.77 1.46 3.32 -0.90 -1.94 116.42 118.93 1n0f h ASP 72 Ca 0.37 -0.42 0.08 0.00 0.02 0.00 0.00 57.03 57.08 1n0f h ASP 72 Cb 0.48 -0.24 -0.05 0.00 0.22 0.00 0.00 39.33 39.75 1n0f h ASP 72 CO -0.34 1.09 0.50 0.15 -1.72 0.00 0.00 179.24 178.92 1n0f h PHE 73 N 0.62 0.78 0.16 4.55 3.57 0.56 0.13 116.94 127.32 1n0f h PHE 73 Ca 0.08 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.60 1n0f h PHE 73 Cb 0.78 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 39.26 1n0f h PHE 73 CO 0.06 0.39 -0.13 0.37 -2.23 0.00 0.00 178.31 176.77 1n0f h GLN 74 N 0.75 -0.29 -0.85 1.11 5.75 0.08 -1.80 115.11 119.86 1n0f h GLN 74 Ca 0.34 0.02 -0.03 0.00 -0.15 0.00 0.00 58.65 58.83 1n0f h GLN 74 Cb 0.36 0.07 -0.04 0.00 1.07 0.00 0.00 27.48 28.94 1n0f h GLN 74 CO -0.12 -0.19 0.41 0.87 -2.65 0.00 0.00 178.83 177.14 1n0f h LYS 75 N -0.30 1.22 -0.36 1.69 1.57 -0.35 -2.77 116.57 117.27 1n0f h LYS 75 Ca -0.00 -0.18 0.03 0.00 -1.87 0.00 0.00 60.65 58.63 1n0f h LYS 75 Cb 0.28 -0.22 -0.03 0.00 0.08 0.00 0.00 32.23 32.33 1n0f h LYS 75 CO -0.02 0.94 0.17 -0.92 -0.57 0.00 0.00 179.45 179.05 1n0f h TYR 76 N 1.21 0.31 -0.45 -1.35 3.20 -0.53 -2.87 116.97 116.49 1n0f h TYR 76 Ca 0.29 0.02 0.06 0.00 3.14 0.00 0.00 58.73 62.23 1n0f h TYR 76 Cb 0.12 -0.09 -0.05 0.00 1.54 0.00 0.00 36.73 38.25 1n0f h TYR 76 CO 0.02 0.16 0.16 0.35 -1.64 0.00 0.00 178.16 177.21 1n0f h PHE 77 N 0.35 0.29 -0.96 -3.82 3.57 -1.06 -1.92 116.94 113.39 1n0f h PHE 77 Ca 0.15 0.02 0.17 0.00 3.53 0.00 0.00 57.97 61.84 1n0f h PHE 77 Cb 0.08 -0.06 -0.10 0.00 2.79 0.00 0.00 35.95 38.65 1n0f h PHE 77 CO -0.11 0.11 0.56 0.93 -2.23 0.00 0.00 178.31 177.57 1n0f h GLU 78 N 0.34 0.73 0.00 1.11 5.08 -1.30 0.56 114.58 121.10 1n0f h GLU 78 Ca 0.21 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 1n0f h GLU 78 Cb 0.20 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.28 1n0f h GLU 78 CO -0.21 0.49 0.08 1.04 -1.00 0.00 0.00 179.01 179.41 1n0f n GLN 79 N -4.78 0.07 -0.08 2.33 6.02 -0.72 -0.85 117.38 119.37 1n0f n GLN 79 Ca 0.21 0.54 -0.23 0.00 -0.01 0.00 0.00 57.00 57.51 1n0f n GLN 79 Cb 0.50 -1.82 -0.12 0.00 1.02 0.00 0.00 30.24 29.82 1n0f n GLN 79 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 1n0f n PHE 80 N -1.88 0.84 0.19 1.08 3.72 0.19 -4.08 117.46 117.53 1n0f n PHE 80 Ca -0.01 0.29 0.05 0.00 -0.05 0.00 0.00 57.45 57.73 1n0f n PHE 80 Cb 0.10 -1.09 0.25 0.00 -0.94 0.00 0.00 39.48 37.79 1n0f n PHE 80 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 176.76 175.80 1n0f h ASN 81 N -0.65 0.00 -0.02 4.37 4.21 -0.64 2.11 115.58 124.95 1n0f h ASN 81 Ca -0.45 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.06 1n0f h ASN 81 Cb 1.59 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.79 1n0f h ASN 81 CO -0.16 0.00 0.00 -1.54 -1.29 0.00 0.00 177.43 174.44 1n0f n SER 82 N -2.03 0.19 -4.70 5.81 3.41 -1.18 -4.74 113.62 110.38 1n0f n SER 82 Ca -0.01 -1.63 -0.35 0.00 -0.26 0.00 0.00 58.87 56.63 1n0f n SER 82 Cb 0.51 -0.02 -0.09 0.00 -0.26 0.00 0.00 64.21 64.35 1n0f n SER 82 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1n0f s PHE 83 N -1.97 3.30 0.00 7.33 0.08 0.71 -5.04 117.98 122.39 1n0f s PHE 83 Ca 0.20 0.19 0.00 0.00 0.12 0.00 0.00 56.93 57.44 1n0f s PHE 83 Cb 0.09 -1.97 0.00 0.00 -0.57 0.00 0.00 43.02 40.57 1n0f s PHE 83 CO 0.15 0.35 0.00 -2.30 -0.10 0.00 0.00 175.22 173.33 1n0f n PRO 84 N 2.85 0.00 0.00 0.24 -0.02 -1.26 -4.77 135.00 132.04 1n0f n PRO 84 Ca -0.18 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.30 1n0f n PRO 84 Cb 0.53 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.01 1n0f n PRO 84 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1n0f n SER 85 N -1.71 0.00 0.02 2.55 2.88 -1.26 -4.62 113.62 111.47 1n0f n SER 85 Ca 0.00 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 57.66 1n0f n SER 85 Cb 0.00 0.00 0.17 0.00 -0.75 0.00 0.00 64.21 63.63 1n0f n SER 85 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1n0f n THR 86 N -1.02 0.11 -3.01 2.46 -2.24 -1.26 -4.77 114.28 104.54 1n0f n THR 86 Ca 0.00 -0.11 -0.40 0.00 -2.27 0.00 0.00 64.05 61.27 1n0f n THR 86 Cb 0.00 0.19 -0.05 0.00 -2.10 0.00 0.00 70.33 68.37 1n0f n THR 86 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1n0f s GLN 87 N -3.07 4.44 0.19 -0.78 -1.52 -1.26 -4.98 119.66 112.66 1n0f s GLN 87 Ca 0.08 0.92 -0.14 0.00 -1.95 0.00 0.00 55.36 54.28 1n0f s GLN 87 Cb 0.16 -3.46 0.18 0.00 -0.22 0.00 0.00 33.01 29.68 1n0f s GLN 87 CO 0.73 0.03 1.68 -0.22 -0.25 0.00 0.00 175.29 177.26 1n0f h LYS 88 N 6.80 0.10 -0.80 2.91 3.64 -2.01 -2.39 116.57 124.83 1n0f h LYS 88 Ca -0.40 -0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.00 1n0f h LYS 88 Cb 1.19 -0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 32.95 1n0f h LYS 88 CO 0.76 0.07 0.51 -0.44 -2.27 0.00 0.00 179.45 178.08 1n0f h ASP 89 N 0.11 0.86 -0.68 4.20 3.32 -1.98 -1.92 116.42 120.32 1n0f h ASP 89 Ca 0.25 -0.01 0.08 0.00 0.02 0.00 0.00 57.03 57.37 1n0f h ASP 89 Cb 0.37 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.68 1n0f h ASP 89 CO -0.42 0.60 0.45 0.74 -1.72 0.00 0.00 179.24 178.89 1n0f h THR 90 N 1.01 0.97 -0.00 0.35 2.02 -1.82 0.58 112.91 116.02 1n0f h THR 90 Ca 0.31 -0.21 -0.22 0.00 0.77 0.00 0.00 66.41 67.06 1n0f h THR 90 Cb -0.02 0.29 0.00 0.00 -1.74 0.00 0.00 68.15 66.67 1n0f h THR 90 CO -0.10 0.11 -0.92 0.03 0.37 0.00 0.00 175.52 175.01 1n0f h ARG 91 N 0.62 0.38 -0.04 6.66 3.08 -1.23 -1.62 114.38 122.24 1n0f h ARG 91 Ca 0.31 -0.41 -0.00 0.00 0.07 0.00 0.00 59.98 59.94 1n0f h ARG 91 Cb 0.38 0.11 -0.00 0.00 0.08 0.00 0.00 29.97 30.54 1n0f h ARG 91 CO -0.10 1.08 0.01 1.15 -1.07 0.00 0.00 179.97 181.03 1n0f h THR 92 N 0.22 1.21 -0.28 2.04 2.02 -0.62 -0.05 112.91 117.45 1n0f h THR 92 Ca -0.07 -0.63 0.05 0.00 0.77 0.00 0.00 66.41 66.52 1n0f h THR 92 Cb 1.55 1.57 -0.04 0.00 -1.74 0.00 0.00 68.15 69.49 1n0f h THR 92 CO 0.16 0.17 0.02 0.25 0.37 0.00 0.00 175.52 176.49 1n0f h LEU 93 N -0.19 -0.07 -1.11 2.58 5.85 -0.91 0.28 115.31 121.74 1n0f h LEU 93 Ca 0.01 0.06 -0.08 0.00 0.84 0.00 0.00 57.88 58.71 1n0f h LEU 93 Cb 0.27 0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.38 1n0f h LEU 93 CO 0.00 -0.00 -0.19 0.11 -0.34 0.00 0.00 178.44 178.01 1n0f h LYS 94 N 0.11 0.39 -0.06 1.25 1.57 -1.21 -1.21 116.57 117.41 1n0f h LYS 94 Ca 0.13 -0.12 -0.08 0.00 -1.87 0.00 0.00 60.65 58.71 1n0f h LYS 94 Cb 0.16 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.44 1n0f h LYS 94 CO -0.21 0.57 -0.27 0.00 -0.57 0.00 0.00 179.45 178.98 1n0f h ARG 95 N 0.35 0.29 -1.00 3.15 3.08 -0.26 -1.59 114.38 118.40 1n0f h ARG 95 Ca 0.06 -0.23 0.06 0.00 0.07 0.00 0.00 59.98 59.94 1n0f h ARG 95 Cb 0.55 0.05 -0.07 0.00 0.08 0.00 0.00 29.97 30.58 1n0f h ARG 95 CO 0.04 0.87 0.65 -0.07 -1.07 0.00 0.00 179.97 180.39 1n0f h LEU 96 N -0.22 1.05 0.06 3.04 3.38 -0.34 -2.29 115.31 119.99 1n0f h LEU 96 Ca -0.02 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 1n0f h LEU 96 Cb 0.92 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.45 1n0f h LEU 96 CO 0.06 0.68 -0.03 0.40 0.09 0.00 0.00 178.44 179.64 1n0f h ILE 97 N 1.19 0.00 0.00 1.22 2.04 -1.21 -3.38 117.51 117.37 1n0f h ILE 97 Ca 0.43 -0.43 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1n0f h ILE 97 Cb 0.13 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.21 1n0f h ILE 97 CO -0.16 0.00 0.00 -0.26 0.00 0.00 0.00 178.15 177.73 1n0f h PHE 98 N -0.51 0.00 0.00 1.37 0.04 -1.38 -2.18 116.94 114.29 1n0f h PHE 98 Ca -0.01 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.76 1n0f h PHE 98 Cb 0.06 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.21 1n0f h PHE 98 CO 0.01 0.00 0.00 0.00 -0.60 0.00 0.00 178.31 177.72 1n0f n ALA 99 N -2.06 2.08 0.22 2.45 0.00 -0.86 -2.87 120.51 119.47 1n0f n ALA 99 Ca 0.00 -0.04 0.03 0.00 0.00 0.00 0.00 53.44 53.43 1n0f n ALA 99 Cb 0.26 -1.41 0.03 0.00 0.00 0.00 0.00 19.45 18.33 1n0f n ALA 99 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1n0f n ASN 100 N -1.79 1.59 -4.78 0.00 3.02 -0.84 -5.01 115.26 107.45 1n0f n ASN 100 Ca 0.05 -1.32 -0.32 0.00 -0.03 0.00 0.00 54.58 52.97 1n0f n ASN 100 Cb 0.31 -0.01 0.06 0.00 -0.61 0.00 0.00 39.78 39.53 1n0f n ASN 100 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1n0f s ALA 101 N -0.54 2.41 0.00 5.41 0.00 -1.11 -3.49 121.76 124.45 1n0f s ALA 101 Ca 0.07 0.38 0.00 0.00 0.00 0.00 0.00 51.96 52.42 1n0f s ALA 101 Cb 0.05 -3.28 0.00 0.00 0.00 0.00 0.00 23.12 19.89 1n0f s ALA 101 CO 0.08 -1.45 0.00 0.09 0.00 0.00 0.00 175.76 174.48 1n0f n ASN 102 N -2.91 0.57 -1.82 0.00 5.03 -1.26 -4.65 115.26 110.22 1n0f n ASN 102 Ca 0.09 0.00 -0.02 0.00 0.87 0.00 0.00 54.58 55.53 1n0f n ASN 102 Cb 0.53 0.04 -0.01 0.00 -1.02 0.00 0.00 39.78 39.31 1n0f n ASN 102 CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 1n0f n PHE 103 N -1.03 -1.29 -4.31 3.10 3.72 -1.23 -4.86 117.46 111.56 1n0f n PHE 103 Ca 0.00 0.73 -0.21 0.00 -0.05 0.00 0.00 57.45 57.92 1n0f n PHE 103 Cb 0.06 -2.21 -0.11 0.00 -0.94 0.00 0.00 39.48 36.28 1n0f n PHE 103 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 1n0f s VAL 104 N -0.23 1.70 -0.13 -4.37 1.01 0.48 -4.95 120.40 113.90 1n0f s VAL 104 Ca -0.08 -1.83 -0.08 0.00 0.00 0.00 0.00 61.98 59.99 1n0f s VAL 104 Cb 0.01 -1.74 -0.04 0.00 0.00 0.00 0.00 36.38 34.60 1n0f s VAL 104 CO 0.23 -0.31 0.15 -1.81 0.00 0.00 0.00 175.10 173.36 1n0f s ASP 105 N -2.54 6.38 -0.20 3.32 1.01 -1.26 -1.02 116.67 122.36 1n0f s ASP 105 Ca 0.13 0.45 -0.23 0.00 0.71 0.00 0.00 52.55 53.60 1n0f s ASP 105 Cb -0.06 -2.08 -0.02 0.00 1.01 0.00 0.00 42.92 41.77 1n0f s ASP 105 CO 0.06 0.36 0.76 -0.69 0.21 0.00 0.00 175.17 175.86 1n0f s VAL 106 N -0.74 4.92 1.04 -1.27 1.01 0.95 -4.52 120.40 121.78 1n0f s VAL 106 Ca 0.14 1.46 -0.16 0.00 0.00 0.00 0.00 61.98 63.42 1n0f s VAL 106 Cb -0.12 -4.06 0.21 0.00 0.00 0.00 0.00 36.38 32.41 1n0f s VAL 106 CO 0.03 0.03 1.16 1.51 0.00 0.00 0.00 175.10 177.84 1n0f s ASP 107 N 1.22 2.39 0.25 3.32 3.84 -0.18 -4.82 116.67 122.70 1n0f s ASP 107 Ca 0.34 0.71 -0.03 0.00 -0.00 0.00 0.00 52.55 53.57 1n0f s ASP 107 Cb -0.16 -1.05 0.46 0.00 -1.38 0.00 0.00 42.92 40.78 1n0f s ASP 107 CO 0.11 -3.22 1.80 0.71 -0.00 0.00 0.00 175.17 174.57 1n0f h THR 108 N -1.96 0.86 0.00 2.11 1.35 -1.96 0.14 112.91 113.44 1n0f h THR 108 Ca -0.48 -0.27 0.00 0.00 -0.55 0.00 0.00 66.41 65.12 1n0f h THR 108 Cb 1.30 0.02 0.00 0.00 -1.73 0.00 0.00 68.15 67.74 1n0f h THR 108 CO 0.46 0.14 0.00 0.00 -0.25 0.00 0.00 175.52 175.87 1n0f n ALA 109 N -2.38 2.29 -2.53 6.62 0.00 -1.26 -4.84 120.51 118.40 1n0f n ALA 109 Ca 0.15 -0.03 -0.10 0.00 0.00 0.00 0.00 53.44 53.46 1n0f n ALA 109 Cb 0.33 -1.07 0.01 0.00 0.00 0.00 0.00 19.45 18.73 1n0f n ALA 109 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n0f n GLY 110 N 0.30 0.08 3.70 0.00 0.00 0.47 -4.74 105.19 105.01 1n0f n GLY 110 Ca 0.03 -0.37 -0.31 0.00 0.00 0.00 0.00 46.02 45.37 1n0f n GLY 110 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1n0f s ARG 111 N -4.96 2.63 -0.09 1.61 0.52 -1.25 0.57 118.95 117.97 1n0f s ARG 111 Ca 0.11 -0.78 0.03 0.00 -0.52 0.00 0.00 55.73 54.57 1n0f s ARG 111 Cb -0.05 -2.59 0.01 0.00 0.52 0.00 0.00 34.95 32.84 1n0f s ARG 111 CO 0.14 0.56 -0.18 0.08 0.02 0.00 0.00 175.30 175.92 1n0f s VAL 112 N -1.28 1.61 -0.22 3.52 1.01 0.58 -1.01 120.40 124.61 1n0f s VAL 112 Ca 0.25 -0.74 -0.23 0.00 0.00 0.00 0.00 61.98 61.25 1n0f s VAL 112 Cb -0.12 -1.44 -0.01 0.00 0.00 0.00 0.00 36.38 34.81 1n0f s VAL 112 CO 0.17 0.46 0.76 -0.22 0.00 0.00 0.00 175.10 176.28 1n0f s LEU 113 N 0.66 4.12 -0.25 3.92 0.20 -1.26 -1.47 118.68 124.60 1n0f s LEU 113 Ca -0.13 0.99 -0.21 0.00 0.69 0.00 0.00 54.13 55.46 1n0f s LEU 113 Cb -0.16 -3.10 -0.02 0.00 -0.43 0.00 0.00 46.19 42.48 1n0f s LEU 113 CO 0.04 -0.42 0.67 -0.63 -0.29 0.00 0.00 176.35 175.72 1n0f s ILE 114 N 2.43 4.96 0.38 6.68 1.01 -0.49 -4.95 121.20 131.21 1n0f s ILE 114 Ca 0.33 1.22 -0.24 0.00 0.00 0.00 0.00 60.65 61.97 1n0f s ILE 114 Cb -0.16 -3.97 -0.13 0.00 0.01 0.00 0.00 42.46 38.21 1n0f s ILE 114 CO 0.09 0.02 0.62 -2.65 0.00 0.00 0.00 174.94 173.02 1n0f n PRO 115 N 5.70 0.64 -0.04 2.79 -0.02 -1.26 -4.66 135.00 138.14 1n0f n PRO 115 Ca 0.01 0.23 -0.08 0.00 -2.02 0.00 0.00 63.50 61.63 1n0f n PRO 115 Cb 0.49 -1.51 -0.03 0.00 -0.02 0.00 0.00 33.50 32.43 1n0f n PRO 115 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 1n0f h ASN 116 N 1.02 -0.19 -0.93 2.55 2.35 -1.97 -0.04 115.58 118.36 1n0f h ASN 116 Ca -0.39 0.06 0.05 0.00 -0.55 0.00 0.00 56.30 55.48 1n0f h ASN 116 Cb 1.39 0.13 -0.06 0.00 0.05 0.00 0.00 38.32 39.83 1n0f h ASN 116 CO 0.54 -0.07 0.61 -0.55 -1.65 0.00 0.00 177.43 176.30 1n0f h ASN 117 N 0.00 0.97 -0.31 5.81 7.08 -2.00 -1.48 115.58 125.65 1n0f h ASN 117 Ca 0.10 0.00 -0.15 0.00 -3.08 0.00 0.00 56.30 53.17 1n0f h ASN 117 Cb 0.15 -0.21 -0.00 0.00 -2.08 0.00 0.00 38.32 36.18 1n0f h ASN 117 CO -0.22 0.64 -0.39 -0.07 -2.08 0.00 0.00 177.43 175.31 1n0f h LEU 118 N 1.11 0.88 -1.57 6.14 4.07 -1.80 -0.63 115.31 123.52 1n0f h LEU 118 Ca 0.39 -0.49 0.19 0.00 0.08 0.00 0.00 57.88 58.04 1n0f h LEU 118 Cb 0.12 -0.25 -0.06 0.00 1.08 0.00 0.00 40.66 41.55 1n0f h LEU 118 CO -0.14 1.20 0.56 0.40 -1.08 0.00 0.00 178.44 179.38 1n0f h ILE 119 N 0.59 0.71 0.12 1.22 1.08 -0.02 -2.29 117.51 118.92 1n0f h ILE 119 Ca 0.04 -0.13 -0.24 0.00 -0.39 0.00 0.00 64.86 64.14 1n0f h ILE 119 Cb 0.98 0.30 0.01 0.00 -3.07 0.00 0.00 36.82 35.04 1n0f h ILE 119 CO 0.09 0.07 -1.16 0.78 -0.69 0.00 0.00 178.15 177.24 1n0f h ASN 120 N 0.38 0.40 -0.33 1.72 2.35 -0.97 -2.33 115.58 116.80 1n0f h ASN 120 Ca 0.43 -0.88 0.04 0.00 -0.55 0.00 0.00 56.30 55.34 1n0f h ASN 120 Cb 1.09 -0.13 -0.07 0.00 0.05 0.00 0.00 38.32 39.26 1n0f h ASN 120 CO -0.14 1.52 -0.49 0.44 -1.65 0.00 0.00 177.43 177.11 1n0f h ASP 121 N -0.36 -1.63 -3.41 5.81 3.32 -0.55 -3.27 116.42 116.33 1n0f h ASP 121 Ca -0.24 0.21 -0.55 0.00 0.02 0.00 0.00 57.03 56.48 1n0f h ASP 121 Cb 1.70 0.66 -0.04 0.00 0.22 0.00 0.00 39.33 41.87 1n0f h ASP 121 CO 0.09 -0.36 0.23 0.00 -1.72 0.00 0.00 179.24 177.47 1n0f s ALA 122 N -5.41 3.28 -0.29 3.45 0.00 -1.05 -4.89 121.76 116.85 1n0f s ALA 122 Ca -0.13 0.35 -0.04 0.00 0.00 0.00 0.00 51.96 52.14 1n0f s ALA 122 Cb 0.07 -3.12 -0.11 0.00 0.00 0.00 0.00 23.12 19.95 1n0f s ALA 122 CO 0.54 -0.10 2.16 1.63 0.00 0.00 0.00 175.76 179.99 1n0f n LYS 123 N 3.49 1.40 -1.70 0.00 4.76 -1.23 -4.62 118.16 120.26 1n0f n LYS 123 Ca 0.01 -0.84 -0.38 0.00 -2.87 0.00 0.00 58.31 54.24 1n0f n LYS 123 Cb 0.51 -1.99 0.05 0.00 -1.84 0.00 0.00 35.03 31.76 1n0f n LYS 123 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 1n0f n LEU 124 N 3.22 4.99 0.00 -0.35 4.32 -0.88 -4.86 117.00 123.45 1n0f n LEU 124 Ca 0.30 0.90 0.00 0.00 -0.02 0.00 0.00 56.01 57.19 1n0f n LEU 124 Cb 0.38 -1.51 0.00 0.00 -1.62 0.00 0.00 43.42 40.67 1n0f n LEU 124 CO 0.35 -1.08 0.00 -0.67 -1.22 0.00 0.00 177.39 174.77 1n0f n ASP 125 N -1.07 0.00 -3.49 -1.43 2.03 -1.26 -4.83 116.55 106.50 1n0f n ASP 125 Ca 0.13 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.44 1n0f n ASP 125 Cb 0.46 0.26 -0.05 0.00 -0.72 0.00 0.00 41.12 41.07 1n0f n ASP 125 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 1n0f s LYS 126 N -0.93 0.36 0.00 -0.67 2.20 -1.26 -4.74 119.74 114.70 1n0f s LYS 126 Ca 0.00 0.85 0.00 0.00 -0.36 0.00 0.00 55.97 56.46 1n0f s LYS 126 Cb 0.00 0.44 0.00 0.00 -1.51 0.00 0.00 37.83 36.76 1n0f s LYS 126 CO 0.00 -0.11 0.00 0.39 -0.36 0.00 0.00 175.35 175.27 1n0f n GLU 127 N 4.82 0.00 -3.97 4.03 1.02 -1.26 -4.90 120.64 120.39 1n0f n GLU 127 Ca -0.11 0.01 -0.21 0.00 -0.02 0.00 0.00 57.16 56.82 1n0f n GLU 127 Cb 0.53 -0.02 -0.04 0.00 -0.02 0.00 0.00 31.44 31.89 1n0f n GLU 127 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1n0f s ILE 128 N 0.00 4.12 -0.05 -3.67 -1.09 0.19 -2.19 121.20 118.51 1n0f s ILE 128 Ca 0.00 -1.35 0.01 0.00 -2.23 0.00 0.00 60.65 57.07 1n0f s ILE 128 Cb 0.00 -3.34 0.02 0.00 -1.58 0.00 0.00 42.46 37.56 1n0f s ILE 128 CO 0.00 -0.27 -0.03 -0.69 -1.23 0.00 0.00 174.94 172.71 1n0f s VAL 129 N -2.19 0.49 -0.20 2.92 1.01 -0.51 -1.27 120.40 120.64 1n0f s VAL 129 Ca 0.36 -0.07 -0.04 0.00 0.00 0.00 0.00 61.98 62.24 1n0f s VAL 129 Cb -0.07 -0.55 -0.02 0.00 0.00 0.00 0.00 36.38 35.74 1n0f s VAL 129 CO 0.26 0.23 -0.04 -0.76 0.00 0.00 0.00 175.10 174.79 1n0f s LEU 130 N 1.14 3.02 -0.10 3.92 1.43 0.10 0.45 118.68 128.65 1n0f s LEU 130 Ca -0.08 -0.30 0.04 0.00 -1.03 0.00 0.00 54.13 52.76 1n0f s LEU 130 Cb -0.14 -1.76 0.00 0.00 0.03 0.00 0.00 46.19 44.33 1n0f s LEU 130 CO -0.01 0.04 -0.23 0.27 0.23 0.00 0.00 176.35 176.65 1n0f s ILE 131 N 1.11 2.00 0.26 -0.59 -4.36 -0.66 0.26 121.20 119.22 1n0f s ILE 131 Ca 0.02 -0.99 -0.29 0.00 -0.26 0.00 0.00 60.65 59.13 1n0f s ILE 131 Cb -0.15 -1.73 -0.09 0.00 1.25 0.00 0.00 42.46 41.74 1n0f s ILE 131 CO 0.00 0.55 1.16 -0.83 0.24 0.00 0.00 174.94 176.06 1n0f s GLY 132 N 0.35 2.95 -0.17 6.27 0.00 0.22 -1.68 107.32 115.25 1n0f s GLY 132 Ca -0.18 0.97 0.15 0.00 0.00 0.00 0.00 44.72 45.66 1n0f s GLY 132 CO 0.09 1.67 1.20 -1.06 0.00 0.00 0.00 173.10 174.99 1n0f n GLN 133 N 1.49 1.49 0.00 2.90 1.13 0.22 -4.39 117.38 120.21 1n0f n GLN 133 Ca 0.01 -3.11 0.00 0.00 -1.94 0.00 0.00 57.00 51.95 1n0f n GLN 133 Cb 0.44 -1.30 0.00 0.00 0.11 0.00 0.00 30.24 29.49 1n0f n GLN 133 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 1n0f n PHE 134 N -0.61 0.00 0.04 1.08 7.35 0.83 -3.51 117.46 122.64 1n0f n PHE 134 Ca 0.18 0.00 -0.16 0.00 -0.76 0.00 0.00 57.45 56.72 1n0f n PHE 134 Cb 0.85 0.00 -0.06 0.00 0.35 0.00 0.00 39.48 40.63 1n0f n PHE 134 CO 0.00 0.00 0.00 -0.44 -0.76 0.00 0.00 176.76 175.56 1n0f h ASP 135 N 0.00 0.72 -2.10 -2.13 3.32 -1.95 -2.70 116.42 111.57 1n0f h ASP 135 Ca 0.00 -0.54 -0.05 0.00 0.02 0.00 0.00 57.03 56.46 1n0f h ASP 135 Cb 0.00 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.32 1n0f h ASP 135 CO 0.00 1.34 -0.04 0.00 -1.72 0.00 0.00 179.24 178.82 1n0f n HIS 136 N -3.82 -0.39 -4.85 4.55 1.44 -1.23 -4.74 115.22 106.17 1n0f n HIS 136 Ca -0.08 -0.36 -0.28 0.00 -2.01 0.00 0.00 57.72 54.99 1n0f n HIS 136 Cb 0.82 0.06 -0.15 0.00 0.12 0.00 0.00 29.99 30.85 1n0f n HIS 136 CO 0.00 0.00 0.00 -1.17 -2.81 0.00 0.00 176.34 172.36 1n0f s LEU 137 N 0.00 2.15 -0.09 2.39 2.96 0.01 -0.61 118.68 125.49 1n0f s LEU 137 Ca 0.05 -0.55 0.04 0.00 -0.22 0.00 0.00 54.13 53.45 1n0f s LEU 137 Cb 0.00 -1.17 -0.01 0.00 0.50 0.00 0.00 46.19 45.51 1n0f s LEU 137 CO 0.03 0.23 -0.22 -1.61 -1.32 0.00 0.00 176.35 173.46 1n0f s GLU 138 N -1.13 2.88 -0.21 1.98 2.02 -0.67 0.11 118.70 123.67 1n0f s GLU 138 Ca 0.10 -0.85 -0.08 0.00 0.02 0.00 0.00 54.97 54.16 1n0f s GLU 138 Cb -0.09 -2.30 -0.04 0.00 0.10 0.00 0.00 34.13 31.79 1n0f s GLU 138 CO 0.02 0.29 0.09 0.42 0.02 0.00 0.00 175.26 176.10 1n0f s ILE 139 N 0.08 4.84 0.27 -1.63 1.01 -0.28 -1.64 121.20 123.84 1n0f s ILE 139 Ca -0.10 -0.01 0.07 0.00 0.00 0.00 0.00 60.65 60.62 1n0f s ILE 139 Cb -0.16 -3.22 -0.06 0.00 0.01 0.00 0.00 42.46 39.04 1n0f s ILE 139 CO 0.06 0.40 -0.08 0.26 0.00 0.00 0.00 174.94 175.58 1n0f s TRP 140 N 0.83 1.93 -0.17 3.97 0.52 0.17 -4.19 118.94 122.01 1n0f s TRP 140 Ca 0.05 -0.65 -0.22 0.00 0.02 0.00 0.00 56.10 55.29 1n0f s TRP 140 Cb -0.13 -1.05 -0.03 0.00 -1.15 0.00 0.00 33.47 31.11 1n0f s TRP 140 CO 0.02 0.32 0.68 0.34 0.02 0.00 0.00 176.95 178.33 1n0f s ASP 141 N -3.42 6.79 0.24 2.95 2.15 -1.26 -1.43 116.67 122.69 1n0f s ASP 141 Ca 0.28 0.96 -0.09 0.00 0.43 0.00 0.00 52.55 54.13 1n0f s ASP 141 Cb 0.02 -2.38 0.39 0.00 -0.30 0.00 0.00 42.92 40.65 1n0f s ASP 141 CO 0.11 -0.27 1.61 0.50 -0.17 0.00 0.00 175.17 176.96 1n0f h LYS 142 N 7.31 0.03 -0.32 4.34 3.64 -1.72 0.18 116.57 130.03 1n0f h LYS 142 Ca -0.33 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.04 1n0f h LYS 142 Cb 1.15 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.95 1n0f h LYS 142 CO 0.78 0.02 0.16 -0.22 -2.27 0.00 0.00 179.45 177.93 1n0f h LYS 143 N 0.04 0.45 -0.47 1.90 1.63 -1.92 -1.84 116.57 116.35 1n0f h LYS 143 Ca 0.40 -0.06 -0.00 0.00 -0.85 0.00 0.00 60.65 60.14 1n0f h LYS 143 Cb 0.66 -0.08 -0.02 0.00 -0.60 0.00 0.00 32.23 32.18 1n0f h LYS 143 CO -0.75 0.41 0.29 -0.07 -3.45 0.00 0.00 179.45 175.88 1n0f h LEU 144 N 0.39 0.56 -0.33 5.20 4.07 -1.59 -1.20 115.31 122.40 1n0f h LEU 144 Ca 0.11 -0.04 0.00 0.00 0.08 0.00 0.00 57.88 58.03 1n0f h LEU 144 Cb 0.09 -0.14 -0.02 0.00 1.08 0.00 0.00 40.66 41.68 1n0f h LEU 144 CO -0.02 0.43 0.22 0.22 -1.08 0.00 0.00 178.44 178.22 1n0f h TYR 145 N 0.63 0.42 -0.88 1.13 3.20 -0.85 0.14 116.97 120.76 1n0f h TYR 145 Ca 0.17 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.04 1n0f h TYR 145 Cb -0.03 -0.14 -0.04 0.00 1.54 0.00 0.00 36.73 38.06 1n0f h TYR 145 CO -0.03 0.27 0.52 0.93 -1.64 0.00 0.00 178.16 178.20 1n0f h GLU 146 N 0.45 1.20 -0.31 1.82 5.08 -1.12 0.06 114.58 121.75 1n0f h GLU 146 Ca 0.12 -0.11 -0.10 0.00 -1.00 0.00 0.00 59.36 58.27 1n0f h GLU 146 Cb -0.05 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 28.94 1n0f h GLU 146 CO -0.03 0.85 -0.22 -0.44 -1.00 0.00 0.00 179.01 178.17 1n0f h ASP 147 N 1.22 0.59 -0.37 1.42 3.32 -0.68 0.27 116.42 122.18 1n0f h ASP 147 Ca 0.31 -0.20 -0.02 0.00 0.02 0.00 0.00 57.03 57.15 1n0f h ASP 147 Cb -0.04 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.34 1n0f h ASP 147 CO -0.06 0.81 0.15 0.22 -1.72 0.00 0.00 179.24 178.65 1n0f h TYR 148 N 0.52 0.56 -0.45 4.55 3.20 0.50 -1.23 116.97 124.63 1n0f h TYR 148 Ca 0.08 -0.04 -0.10 0.00 3.14 0.00 0.00 58.73 61.81 1n0f h TYR 148 Cb 0.66 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.75 1n0f h TYR 148 CO 0.03 0.51 -0.12 -0.07 -1.64 0.00 0.00 178.16 176.86 1n0f h LEU 149 N 0.46 0.88 -0.87 2.82 4.07 -0.73 -2.98 115.31 118.96 1n0f h LEU 149 Ca 0.13 -0.37 0.05 0.00 0.08 0.00 0.00 57.88 57.76 1n0f h LEU 149 Cb 0.18 -0.24 -0.06 0.00 1.08 0.00 0.00 40.66 41.62 1n0f h LEU 149 CO -0.01 1.04 0.55 0.00 -1.08 0.00 0.00 178.44 178.94 1n0f h ALA 150 N 0.86 1.16 -3.00 1.53 0.00 -0.22 -3.40 119.26 116.20 1n0f h ALA 150 Ca 0.11 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1n0f h ALA 150 Cb 0.67 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1n0f h ALA 150 CO 0.05 0.35 0.00 0.09 0.00 0.00 0.00 179.25 179.74 1n0f n ASN 151 N -4.58 0.00 -1.73 0.00 3.02 -0.48 -4.99 115.26 106.51 1n0f n ASN 151 Ca 0.12 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.67 1n0f n ASN 151 Cb 0.13 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.30 1n0f n ASN 151 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1n0f n SER 152 N 0.00 -8.95 -2.81 6.41 3.41 -1.24 -4.92 113.62 105.52 1n0f n SER 152 Ca 0.00 1.26 -0.10 0.00 -0.26 0.00 0.00 58.87 59.77 1n0f n SER 152 Cb 0.00 -4.69 0.08 0.00 -0.26 0.00 0.00 64.21 59.34 1n0f n SER 152 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1n0f n GLU 153 N 0.29 -1.49 -1.95 4.33 1.02 -1.26 -5.00 120.64 116.57 1n0f n GLU 153 Ca 0.00 -0.60 -0.33 0.00 -0.02 0.00 0.00 57.16 56.21 1n0f n GLU 153 Cb 0.00 -0.52 0.02 0.00 -0.02 0.00 0.00 31.44 30.92 1n0f n GLU 153 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 1n0f s SER 154 N -2.50 5.52 0.27 1.62 1.04 -1.26 -4.83 113.70 113.55 1n0f s SER 154 Ca 0.24 1.91 -0.02 0.00 0.48 0.00 0.00 55.95 58.56 1n0f s SER 154 Cb -0.02 -2.54 0.43 0.00 0.10 0.00 0.00 66.02 63.98 1n0f s SER 154 CO 0.18 -1.34 1.88 0.25 0.98 0.00 0.00 173.24 175.18 1n0f h LEU 155 N 0.34 1.02 -0.17 2.42 5.85 -1.99 0.13 115.31 122.92 1n0f h LEU 155 Ca -0.47 0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.20 1n0f h LEU 155 Cb 1.23 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 42.06 1n0f h LEU 155 CO 0.56 0.64 -0.17 -0.33 -0.34 0.00 0.00 178.44 178.80 1n0f h GLU 156 N 1.15 0.41 -0.49 1.25 3.07 -1.99 -1.26 114.58 116.72 1n0f h GLU 156 Ca 0.44 -0.21 0.00 0.00 -0.50 0.00 0.00 59.36 59.09 1n0f h GLU 156 Cb 0.21 0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 28.10 1n0f h GLU 156 CO -0.19 0.78 0.32 1.15 -1.40 0.00 0.00 179.01 179.67 1n0f h THR 157 N 0.05 1.13 -0.43 1.13 2.02 -1.80 0.07 112.91 115.08 1n0f h THR 157 Ca 0.03 -0.25 -0.13 0.00 0.77 0.00 0.00 66.41 66.83 1n0f h THR 157 Cb 0.70 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 67.53 1n0f h THR 157 CO 0.04 0.13 -0.26 0.58 0.37 0.00 0.00 175.52 176.38 1n0f h VAL 158 N 0.66 1.27 -0.31 3.16 2.07 -0.78 -3.16 116.25 119.16 1n0f h VAL 158 Ca 0.18 -1.42 -0.04 0.00 0.82 0.00 0.00 66.70 66.24 1n0f h VAL 158 Cb -0.06 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 30.91 1n0f h VAL 158 CO -0.04 0.48 0.05 0.00 0.02 0.00 0.00 177.57 178.09 1n0f h ALA 159 N 0.92 0.42 -0.20 1.67 0.00 -0.78 -2.79 119.26 118.50 1n0f h ALA 159 Ca 0.09 -0.19 0.06 0.00 0.00 0.00 0.00 54.91 54.87 1n0f h ALA 159 Cb 0.82 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1n0f h ALA 159 CO 0.07 0.11 0.37 1.49 0.00 0.00 0.00 179.25 181.29 1n0f h GLU 160 N 0.35 0.00 -0.00 0.00 4.57 -0.95 0.45 114.58 119.00 1n0f h GLU 160 Ca 0.10 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.28 1n0f h GLU 160 Cb 0.34 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.93 1n0f h GLU 160 CO 0.01 0.00 -0.27 0.54 -1.18 0.00 0.00 179.01 178.10 1n0f n ARG 161 N -3.32 0.32 0.00 1.92 1.74 -1.05 -5.12 116.66 111.15 1n0f n ARG 161 Ca 0.02 -0.15 0.07 0.00 -0.77 0.00 0.00 57.85 57.03 1n0f n ARG 161 Cb 0.48 -1.50 0.42 0.00 -1.02 0.00 0.00 32.46 30.84 1n0f n ARG 161 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78